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	hartrees
Energy at 0K	-211.836485
Energy at 298.15K	-211.835514
HF Energy	-211.836485
Nuclear repulsion energy	10.387169

Atom	x (Å)	y (Å)	z (Å)
Be1	0.000	0.000	-1.834
Mg2	0.000	0.000	0.611

	Be1	Mg2
Be1		2.4454
Mg2	2.4454

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Be	-0.468
2	Mg	0.468

	x	y	z	Total
	0.000	0.000	5.715	5.715
CHELPG
AIM
ESP

All results from a given calculation for BeMg (Beryllium Magnesium)

using model chemistry: PBE1PBE/STO-3G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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<r²>	27.518
(<r²>)^1/2	5.246